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| CAS No.: | 16154-69-1 |
|---|---|
| Name: | 4-(4-BENZYLPIPERAZINO)ANILINE |
| Article Data: | 8 |
| Molecular Structure: | |
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| Formula: | C17H21N3 |
| Molecular Weight: | 267.374 |
| Synonyms: | Piperazine,1-(p-aminophenyl)-4-benzyl- (8CI);4-(4-Benzylpiperazin-1-yl)aniline;4-(4-Benzylpiperazin-1-yl)phenylamine;4-[4-(Phenylmethyl)-1-piperazinyl]benzenamine; |
| Density: | 1.145 g/cm3 |
| Melting Point: | 140-142 °C |
| Boiling Point: | 446.3 °C at 760 mmHg |
| Flash Point: | 220.1 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | Xi:Irritant; ">  Xi:Irritant; |
| PSA: | 32.50000 |
| LogP: | 3.17510 |
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- Total:29 Page 1 of 1 1
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Specification
The Benzenamine,4-[4-(phenylmethyl)-1-piperazinyl]- is an organic compound with the formula C17H21N3. The IUPAC name of this chemical is (2S)-2-Amino-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-3-phenylpropanamide. With the CAS registry number 16154-69-1, it is also named as 1-(4-Aminophenyl)-4-benzylpiperazine. Besides, its molecular weight is 267.37.
Physical properties about Benzenamine,4-[4-(phenylmethyl)-1-piperazinyl]- are: (1)ACD/LogP: 2.02; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 9.72 Å2; (6)Index of Refraction: 1.633; (7)Molar Refractivity: 83.42 cm3; (8)Molar Volume: 233.3 cm3; (9)Polarizability: 33.07×10-24 cm3; (10)Surface Tension: 52.7 dyne/cm; (11)Density: 1.145 g/cm3; (12)Flash Point: 220.1 °C; (13)Enthalpy of Vaporization: 70.44 kJ/mol; (14)Boiling Point: 446.3 °C at 760 mmHg; (15)Vapour Pressure: 3.68E-08 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C17H21N3/c18-16-6-8-17(9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14,18H2
(2)InChIKey: PZWVVLZWQWIEAV-UHFFFAOYAM
(3)Std. InChI: InChI=1S/C17H21N3/c18-16-6-8-17(9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14,18H2
(4)Std. InChIKey: PZWVVLZWQWIEAV-UHFFFAOYSA-N